(2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl-(thiophen-2-ylmethyl)azanium Openeye Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl-(2-thienylmethyl)ammonium CAS Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-4-yl)methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl-(thiophen-2-ylmethyl)azanium Traditional Name: (2-keto-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl-(2-thenyl)ammonium Formula: C18H18NO2S+ MolecularWeight: 312.40602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)C[NH2+]CC4=CC=CS4

Isomeric SMILES

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)C[NH2+]CC4=CC=CS4

InChI

InChI=1S/C18H17NO2S/c20-18-9-14(10-19-11-15-5-2-6-22-15)16-7-12-3-1-4-13(12)8-17(16)21-18/h2,5-9,19H,1,3-4,10-11H2/p+1